N-benzyl-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-benzyl-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-benzyl-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0160 |
| Compound Name: | N-benzyl-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 562.61 |
| Molecular Formula: | C26 H28 N2 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cc(C)c(cc1C)S(Nc1ccc(cc1)C1(CC1)C(NCc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2275 |
| logD: | 5.1692 |
| logSw: | -5.1045 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.553 |
| InChI Key: | JYIRXTWDVIXCLW-UHFFFAOYSA-N |